N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide

C13H20N2O4S — CID 58835324

IUPACN-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide
SMILESCCC(C)(C)c1ccc(S(=O)(=O)NCC(=O)NO)cc1
InChIInChI=1S/C13H20N2O4S/c1-4-13(2,3)10-5-7-11(8-6-10)20(18,19)14-9-12(16)15-17/h5-8,14,17H,4,9H2,1-3H3,(H,15,16)
InChIKeyZGTGCCFAUYUWJW-UHFFFAOYSA-N
MW300.38 g/mol
LogP1.16
Rot. Bonds6

About N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide

N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide (PubChem CID 58835324) has the molecular formula C13H20N2O4S and a molecular weight of 300.38 g/mol. Its IUPAC name is N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide
PubChem CID58835324
Molecular FormulaC13H20N2O4S
Molecular Weight300.38 g/mol
Exact Mass300.11
IUPAC NameN-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide
SMILESCCC(C)(C)c1ccc(S(=O)(=O)NCC(=O)NO)cc1
InChIInChI=1S/C13H20N2O4S/c1-4-13(2,3)10-5-7-11(8-6-10)20(18,19)14-9-12(16)15-17/h5-8,14,17H,4,9H2,1-3H3,(H,15,16)
InChIKeyZGTGCCFAUYUWJW-UHFFFAOYSA-N
XLogP1.16
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-butan-2-yl-2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 112990855
N-butyl-2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 112990709
2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 9189386
N-(cyclohexylmethyl)-4-(2-methylbutan-2-yl)benzenesulfonamide
CID 6733441
diethyl 2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]propanedioate
CID 3752840
2-[4-(2-methylbutan-2-yl)phenoxy]-N-[4-(propylsulfamoyl)phenyl]acetamide
CID 17093270
N-tert-butyl-2-[[4-(ethylamino)phenyl]sulfonylamino]acetamide
CID 115357166
4-tert-butyl-N-ethylbenzenesulfonamide
CID 846956
N-(4-tert-butylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetamide
CID 9203847
2-[(4-tert-butylphenyl)sulfonylamino]-N-[4-(dimethylamino)phenyl]acetamide
CID 110601053
2-[(4-tert-butylphenyl)sulfonylamino]-N-(4-cyanophenyl)acetamide
CID 113002113
3-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]thiophene-2-carboxylate
CID 59180411

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide?
The IUPAC name of N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide (CID 58835324) is N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide.
What is the SMILES notation for N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide?
The canonical SMILES for N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide is CCC(C)(C)c1ccc(S(=O)(=O)NCC(=O)NO)cc1.
What is the InChIKey of N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide?
The InChIKey is ZGTGCCFAUYUWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4S/c1-4-13(2,3)10-5-7-11(8-6-10)20(18,19)14-9-12(16)15-17/h5-8,14,17H,4,9H2,1-3H3,(H,15,16).
What are the key properties of N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide?
N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide has a molecular weight of 300.38 g/mol, XLogP of 1.16, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]acetamide is sourced from PubChem (CID 58835324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).